Vitas-M small molecule compound

7-benzyl-8-(ethylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK833816
SMILES CCSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C15H16N4O2S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O2S/c1-3-22-15-16-12-11(13(20)17-14(21)18(12)2)19(15)9-10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H,17,20,21)
InChIKey
QIPGFAUHQAODRI-UHFFFAOYSA-N
Synonyms
301354-18-7
301354187
7benzyl8(ethylsulfanyl)3methyl37dihydro1Hpurine26dione
7BENZYL8(ETHYLTHIO)3METHYL1HPURINE26(3H7H)DIONE
7BENZYL8ETHYLSULFANYL3METHYL37DIHYDROPURINE26DIONE
7BENZYL8ETHYLSULFANYL3METHYLPURINE26DIONE
CCSC1=NC2=C(N1CC3=CC=CC=C3)C(=O)NC(=O)N2C
CCSc1nc2c(n1Cc1ccccc1)c(=O)(nH)c(=O)n2C
InChI=1SC15H16N4O2Sc132215161211(13(20)1714(21)18(12)2)19(15)9107546810h48H39H212H3(H172021)
MFCD00612630
ZINC000000332386
ZINC00332386
ZINC332386

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Available files

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